N-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide

C22H23N3O5S — CID 53161501

IUPACN-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc(C)n(CC(=O)NCc3ccccc3)c2=O)cc1
InChIInChI=1S/C22H23N3O5S/c1-16-8-13-20(24-31(28,29)19-11-9-18(30-2)10-12-19)22(27)25(16)15-21(26)23-14-17-6-4-3-5-7-17/h3-13,24H,14-15H2,1-2H3,(H,23,26)
InChIKeyCUJORASAYYTVNH-UHFFFAOYSA-N
MW441.51 g/mol
LogP2.28
Rot. Bonds8

About N-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide

N-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide (PubChem CID 53161501) has the molecular formula C22H23N3O5S and a molecular weight of 441.51 g/mol. Its IUPAC name is N-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide
PubChem CID53161501
Molecular FormulaC22H23N3O5S
Molecular Weight441.51 g/mol
Exact Mass441.14
IUPAC NameN-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc(C)n(CC(=O)NCc3ccccc3)c2=O)cc1
InChIInChI=1S/C22H23N3O5S/c1-16-8-13-20(24-31(28,29)19-11-9-18(30-2)10-12-19)22(27)25(16)15-21(26)23-14-17-6-4-3-5-7-17/h3-13,24H,14-15H2,1-2H3,(H,23,26)
InChIKeyCUJORASAYYTVNH-UHFFFAOYSA-N
XLogP2.28
TPSA106.50 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.51
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 87050347
2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]-N-(pyridin-4-ylmethyl)acetamide
CID 87050645
N-(2-methoxyphenyl)-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide
CID 53161468
N-benzyl-2-(3-cyano-6-methyl-2-oxo-1-pyridinyl)acetamide
CID 82099380
N-[2-(diaminomethylideneamino)oxyethyl]-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide
CID 22178641
2-(benzenesulfonamido)-N-[(4-methoxyphenyl)methyl]acetamide
CID 112992791
2-[6-methyl-3-[(3-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetic acid
CID 12072027
N-[(4-methoxyphenyl)methyl]-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 17192613
2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-[(3-bromophenyl)methyl]acetamide
CID 87050372
N-benzyl-3-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 7542047
2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]-N-(oxolan-2-ylmethyl)acetamide
CID 53161461
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide?
The IUPAC name of N-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide (CID 53161501) is N-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide.
What is the SMILES notation for N-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide?
The canonical SMILES for N-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide is COc1ccc(S(=O)(=O)Nc2ccc(C)n(CC(=O)NCc3ccccc3)c2=O)cc1.
What is the InChIKey of N-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide?
The InChIKey is CUJORASAYYTVNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O5S/c1-16-8-13-20(24-31(28,29)19-11-9-18(30-2)10-12-19)22(27)25(16)15-21(26)23-14-17-6-4-3-5-7-17/h3-13,24H,14-15H2,1-2H3,(H,23,26).
What are the key properties of N-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide?
N-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide has a molecular weight of 441.51 g/mol, XLogP of 2.28, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[3-[(4-methoxyphenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]acetamide is sourced from PubChem (CID 53161501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).